mail[bug #10320] bug in model-free.py; All residues must either have a local tm parameter or not


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Posted by anonymous on November 13, 2007 - 17:57:

URL:
  <http://gna.org/bugs/?10320>

                 Summary: bug in model-free.py; All residues must either have
a local tm parameter or not
                 Project: relax
            Submitted by: None
            Submitted on: Tuesday 11/13/2007 at 17:57 CET
                Category: relax's source code
                Severity: 3 - Normal
                Priority: 5 - Normal
                  Status: None
                 Privacy: Public
             Assigned to: None
         Originator Name: doug
        Originator Email: 
             Open/Closed: Open
         Discussion Lock: Any
                 Release: Repository: 1.2 line
        Operating System: None

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Details:

SVN 3357

I have encountered the following bug
(https://mail.gna.org/public/relax-users/2007-10/msg00028.html) when running
the full_analysis.py script, which seems to involve the model-free.py file.


I've attached a save state file before (relax_state_before_eliminate.bz2) and
after (relax_state_20072910_155552.bz2) the error.  FYI: there was difficultly
in the optimization of the oblate tensor for these data, so I stopped the
optimization and used the last calculation; this should not affect the error
reported above, as this error has been reproduced on a few other datasets. 




relax> state.save(file='relax_state_20072910_155552', dir=None, force=0,
compress_type=1)
Opening the file 'relax_state_20072910_155552.bz2' for writing.
Traceback (most recent call last):
  File "full_analysis.py", line 581, in ?
    Main(self.relax)
  File "full_analysis.py", line 296, in __init__
    self.model_selection(run='final', write_flag=0)
  File "full_analysis.py", line 517, in model_selection
    eliminate()
  File "/opt/relax/1.2/prompt/eliminate.py", line 97, in eliminate
    self.relax.generic.eliminate.eliminate(run=run, function=function,
args=args)
  File "/opt/relax/1.2/generic_fns/eliminate.py", line 56, in eliminate
    for i in xrange(num_instances(self.run)):
  File "/opt/relax/1.2/specific_fns/model_free.py", line 2595, in
num_instances
    self.param_set = self.determine_param_set_type()
  File "/opt/relax/1.2/specific_fns/model_free.py", line 1035, in
determine_param_set_type
    raise RelaxError, "All residues must either have a local tm parameter or
not."
RelaxError: RelaxError: All residues must either have a local tm parameter or
not.








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File Attachments:


-------------------------------------------------------
Date: Tuesday 11/13/2007 at 17:57 CET  Name: relax_state_before_eliminate.bz2
 Size: 56kB   By: None

<http://gna.org/bugs/download.php?file_id=3198>
-------------------------------------------------------
Date: Tuesday 11/13/2007 at 17:57 CET  Name: relax_state_20072910_155552.bz2 
Size: 56kB   By: None

<http://gna.org/bugs/download.php?file_id=3199>

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